N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide

C14H13ClN2O — CID 103769247

IUPACN-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide
SMILESCc1cccc(C)c1C(=O)Nc1cnccc1Cl
InChIInChI=1S/C14H13ClN2O/c1-9-4-3-5-10(2)13(9)14(18)17-12-8-16-7-6-11(12)15/h3-8H,1-2H3,(H,17,18)
InChIKeyFYZCNYMBPMGPHV-UHFFFAOYSA-N
MW260.72 g/mol
LogP3.60
Rot. Bonds2

About N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide

N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide (PubChem CID 103769247) has the molecular formula C14H13ClN2O and a molecular weight of 260.72 g/mol. Its IUPAC name is N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide.

Molecular Properties

Compound NameN-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide
PubChem CID103769247
Molecular FormulaC14H13ClN2O
Molecular Weight260.72 g/mol
Exact Mass260.07
IUPAC NameN-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide
SMILESCc1cccc(C)c1C(=O)Nc1cnccc1Cl
InChIInChI=1S/C14H13ClN2O/c1-9-4-3-5-10(2)13(9)14(18)17-12-8-16-7-6-11(12)15/h3-8H,1-2H3,(H,17,18)
InChIKeyFYZCNYMBPMGPHV-UHFFFAOYSA-N
XLogP3.60
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chloro-3-pyridinyl)-2-fluoro-3-methylbenzamide
CID 80712464
(4-chloro-3-pyridinyl)carbamic acid
CID 54010428
2-chloro-6-methyl-N-pyridin-4-ylbenzamide
CID 59618146
2-amino-6-chloro-N-(3-methyl-4-pyridinyl)benzamide
CID 63669500
N-(4-chloro-3-pyridinyl)-2-iodobenzamide
CID 78965019
2,6-difluoro-N-(4-methyl-3-pyridinyl)benzamide
CID 155976888
3-chloro-N-(2,3-dimethylphenyl)pyridine-4-carboxamide
CID 66462249
3-amino-2-chloro-N-(4-chloro-3-pyridinyl)benzamide
CID 112576138
N-(4-chloro-3-pyridinyl)thiophene-2-carboxamide
CID 78965933
4-chloro-N-(2-cyano-3-methylphenyl)pyridine-3-carboxamide
CID 114003049
6-chloro-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide
CID 63327625
2-amino-3-chloro-N-(3-methyl-4-pyridinyl)benzamide
CID 113331765

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide?
The IUPAC name of N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide (CID 103769247) is N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide.
What is the SMILES notation for N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide?
The canonical SMILES for N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide is Cc1cccc(C)c1C(=O)Nc1cnccc1Cl.
What is the InChIKey of N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide?
The InChIKey is FYZCNYMBPMGPHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c1-9-4-3-5-10(2)13(9)14(18)17-12-8-16-7-6-11(12)15/h3-8H,1-2H3,(H,17,18).
What are the key properties of N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide?
N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide has a molecular weight of 260.72 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide is sourced from PubChem (CID 103769247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).